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SCH-599473
SpectraBase Compound ID 1NOccyrz4j5
InChI InChI=1S/C25H40O5S/c1-18-10-11-23-24(3,4)13-7-14-25(23,5)21(18)16-22(30-31(26,27)28)19(2)8-6-9-20-12-15-29-17-20/h12,15,17,19,22-23H,6-11,13-14,16H2,1-5H3,(H,26,27,28)/p-1/t19?,22?,23?,25-/m1/s1
InChIKey YICNPTBJXHDYCL-SUYMLYTFSA-M
Mol Weight 451.6 g/mol
Molecular Formula C25H39O5S
Exact Mass 451.251821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ACh4lPFIVm
Name SCH-599473
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H39O5S
InChI InChI=1S/C25H40O5S/c1-18-10-11-23-24(3,4)13-7-14-25(23,5)21(18)16-22(30-31(26,27)28)19(2)8-6-9-20-12-15-29-17-20/h12,15,17,19,22-23H,6-11,13-14,16H2,1-5H3,(H,26,27,28)/p-1/t19?,22?,23?,25-/m1/s1
InChIKey YICNPTBJXHDYCL-SUYMLYTFSA-M
Literature Reference Author S.W.YANG,T.M.CHAN,S.A.POMPONI,W.GONSIOREK,G.CHEN,A.E.WRIGHT, W.HIPKIN,M.PATEL,V.G
Literature Reference Citation J.ANTIBIOTICS,56,783(2003)
Literature Reference DOI 10.7164/antibiotics.56.783
Molecular Weight 451.642 g/mol
Solvent DMSO-D6
Source File Reference UWSP730